| SpectraBase Compound ID | C87e0eXSqli |
|---|---|
| InChI | InChI=1S/C12H25NO2/c1-9(2)6-7-13-11(8-10(3)4)12(14)15-5/h9-11,13H,6-8H2,1-5H3 |
| InChIKey | BGZAZLKECHMJKQ-UHFFFAOYSA-N |
| Mol Weight | 215.34 g/mol |
| Molecular Formula | C12H25NO2 |
| Exact Mass | 215.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B182ck9U1uW |
|---|---|
| Name | L-Leucine, N-(3-methylbutyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.188529047 u |
| Formula | C12H25NO2 |
| InChI | InChI=1S/C12H25NO2/c1-9(2)6-7-13-11(8-10(3)4)12(14)15-5/h9-11,13H,6-8H2,1-5H3 |
| InChIKey | BGZAZLKECHMJKQ-UHFFFAOYSA-N |
| Molecular Weight | 215.337 g/mol |
| SMILES | COC(C(CC(C)C)NCCC(C)C)=O |